2-[[3-oxidanyl-9,10-bis(oxidanylidene)anthracen-2-yl]carbamoyl]benzoic acid

Systemtic Name: 2-[[3-oxidanyl-9,10-bis(oxidanylidene)anthracen-2-yl]carbamoyl]benzoic acid Openeye Name: 2-[(3-hydroxy-9,10-dioxo-2-anthryl)carbamoyl]benzoic acid CAS Name: 2-[[(3-hydroxy-9,10-dioxo-2-anthracenyl)amino]-oxomethyl]benzoic acid IUPAC Name: 2-[(3-hydroxy-9,10-dioxoanthracen-2-yl)carbamoyl]benzoic acid Traditional Name: 2-[(3-hydroxy-9,10-diketo-2-anthryl)carbamoyl]benzoic acid Formula: C22H13NO6 MolecularWeight: 387.34172

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)C3=CC(=C(C=C3C2=O)O)NC(=O)C4=CC=CC=C4C(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)C3=CC(=C(C=C3C2=O)O)NC(=O)C4=CC=CC=C4C(=O)O

InChI

InChI=1S/C22H13NO6/c24-18-10-16-15(19(25)11-5-1-2-6-12(11)20(16)26)9-17(18)23-21(27)13-7-3-4-8-14(13)22(28)29/h1-10,24H,(H,23,27)(H,28,29)